methyl 5-(3-oxidanylprop-1-ynyl)-8-(phenylcarbonyloxy)-1,6-naphthyridine-7-carboxylate

Systemtic Name: methyl 5-(3-oxidanylprop-1-ynyl)-8-(phenylcarbonyloxy)-1,6-naphthyridine-7-carboxylate Openeye Name: methyl 8-benzoyloxy-5-(3-hydroxyprop-1-ynyl)-1,6-naphthyridine-7-carboxylate CAS Name: 8-benzoyloxy-5-(3-hydroxyprop-1-ynyl)-1,6-naphthyridine-7-carboxylic acid methyl ester IUPAC Name: methyl 8-benzoyloxy-5-(3-hydroxyprop-1-ynyl)-1,6-naphthyridine-7-carboxylate Traditional Name: 8-benzoyloxy-5-(3-hydroxyprop-1-ynyl)-1,6-naphthyridine-7-carboxylic acid methyl ester Formula: C20H14N2O5 MolecularWeight: 362.33556

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NC(=C2C=CC=NC2=C1OC(=O)C3=CC=CC=C3)C#CCO

Isomeric SMILES

COC(=O)C1=NC(=C2C=CC=NC2=C1OC(=O)C3=CC=CC=C3)C#CCO

InChI

InChI=1S/C20H14N2O5/c1-26-20(25)17-18(27-19(24)13-7-3-2-4-8-13)16-14(9-5-11-21-16)15(22-17)10-6-12-23/h2-5,7-9,11,23H,12H2,1H3